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KKY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C07C04sing1.51Å1.52Å
C04C03doub1.38Å1.39ÅAromatic
C04C05sing1.39Å1.39ÅAromatic
C03C02sing1.39Å1.40ÅAromatic
C05C06doub1.38Å1.40ÅAromatic
C02N02sing1.39Å1.36Å
C02N01doub1.32Å1.35ÅAromatic
C06N01sing1.32Å1.36ÅAromatic
C06C08sing1.51Å1.51Å
F13C13sing1.35Å1.35Å
C08C09sing1.53Å1.52Å
C13C14doub1.38Å1.39ÅAromatic
C13C12sing1.38Å1.39ÅAromatic
C14C15sing1.38Å1.39ÅAromatic
C12C11doub1.38Å1.39ÅAromatic
C15C17sing1.51Å1.51Å
C15C16doub1.38Å1.39ÅAromatic
C11C16sing1.38Å1.40ÅAromatic
C11C09sing1.51Å1.51Å
C17C18sing1.53Å1.52Å
C18C22sing1.53Å1.53Å
C23C22sing1.55Å1.52Å
C23C24sing1.55Å1.52Å
C22N21sing1.48Å1.48Å
C24C25sing1.54Å1.52Å
N21C25sing1.48Å1.47Å
N21C26sing1.47Å1.46Å
C17H1sing1.09Å1.10Å
C17H2sing1.09Å1.10Å
C22H3sing1.09Å1.10Å
C03H4sing1.08Å1.08Å
C05H5sing1.08Å1.08Å
C07H6sing1.09Å1.10Å
C07H7sing1.09Å1.10Å
C07H8sing1.09Å1.10Å
C08H9sing1.09Å1.10Å
C08H10sing1.09Å1.10Å
C09H11sing1.09Å1.10Å
C09H12sing1.09Å1.10Å
C14H13sing1.08Å1.08Å
C23H14sing1.09Å1.10Å
C23H15sing1.09Å1.10Å
C25H16sing1.09Å1.10Å
C25H17sing1.09Å1.10Å
C12H18sing1.08Å1.08Å
C16H19sing1.08Å1.08Å
C18H20sing1.09Å1.10Å
C18H21sing1.09Å1.10Å
C24H22sing1.09Å1.10Å
C24H23sing1.09Å1.10Å
C26H24sing1.09Å1.10Å
C26H25sing1.09Å1.10Å
C26H26sing1.09Å1.10Å
N02H27sing0.97Å1.00Å
N02H28sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C07C04C03121.1°120.7°
C07C04C05119.4°120.8°
C04C07H6109.5°109.5°
C04C07H7109.5°109.4°
C04C07H8109.5°109.5°
C03C04C05119.5°118.5°
C04C03C02119.2°119.1°
C04C03H4120.4°120.4°
C04C05C06119.5°119.3°
C04C05H5120.3°120.3°
C03C02N02120.6°119.7°
C03C02N01120.5°120.6°
C02C03H4120.4°120.5°
C05C06N01120.4°120.9°
C05C06C08119.4°119.5°
C06C05H5120.2°120.4°
N02C02N01118.9°119.7°
C02N02H27109.5°120.0°
C02N02H28109.5°120.0°
C02N01C06120.9°121.6°
N01C06C08120.2°119.6°
C06C08C09108.8°109.5°
C06C08H9109.6°109.5°
C06C08H10109.6°109.5°
F13C13C14119.7°120.0°
F13C13C12120.0°120.0°
C08C09C11108.9°109.5°
C09C08H9109.7°109.5°
C09C08H10109.6°109.4°
C08C09H11109.6°109.5°
C08C09H12109.6°109.4°
C14C13C12120.2°120.0°
C13C14C15120.2°120.0°
C13C14H13119.9°120.0°
C13C12C11119.8°119.9°
C13C12H18120.1°120.1°
C14C15C17118.0°120.0°
C14C15C16119.8°120.0°
C15C14H13119.9°120.0°
C12C11C16120.2°120.0°
C12C11C09117.8°120.0°
C11C12H18120.1°120.0°
C17C15C16122.2°120.0°
C15C17C18112.1°109.5°
C15C17H1108.8°109.5°
C15C17H2108.8°109.5°
C15C16C11119.8°120.1°
C15C16H19120.1°120.0°
C16C11C09121.9°120.0°
C11C16H19120.1°119.9°
C11C09H11109.6°109.5°
C11C09H12109.6°109.5°
C17C18C22110.2°109.5°
C18C17H1108.8°109.5°
C18C17H2108.8°109.5°
C17C18H20109.3°109.5°
C17C18H21109.3°109.5°
C18C22C23111.3°110.5°
C18C22N21111.5°110.3°
C18C22H3108.6°110.4°
C22C18H20109.3°109.4°
C22C18H21109.3°109.5°
C22C23C24105.5°101.7°
C23C22N21107.5°104.8°
C23C22H3108.6°110.4°
C22C23H14110.5°111.0°
C22C23H15110.5°111.0°
C23C24C25105.2°103.0°
C24C23H14110.5°111.0°
C24C23H15110.5°110.9°
C23C24H22110.5°110.6°
C23C24H23110.5°110.7°
C22N21C25109.1°108.5°
C22N21C26108.5°111.0°
N21C22H3109.3°110.4°
C24C25N21107.2°107.2°
C24C25H16110.0°109.9°
C24C25H17110.0°109.9°
C25C24H22110.5°110.7°
C25C24H23110.5°110.7°
C25N21C26108.5°111.0°
N21C25H16110.0°109.8°
N21C25H17110.0°110.0°
N21C26H24109.5°109.5°
N21C26H25109.5°109.5°
N21C26H26109.5°109.5°
H1C17H2109.5°109.4°
H6C07H7109.5°109.5°
H6C07H8109.4°109.5°
H7C07H8109.5°109.5°
H9C08H10109.5°109.4°
H11C09H12109.5°109.4°
H14C23H15109.5°110.9°
H16C25H17109.4°109.9°
H20C18H21109.5°109.5°
H22C24H23109.5°110.8°
H24C26H25109.4°109.5°
H24C26H26109.5°109.5°
H25C26H26109.5°109.4°
H27N02H28109.4°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C07C04C03C05179.1°180.0°
C07C04C03C02179.6°180.0°
C07C04C05C06179.2°180.0°
C07C04C03H40.5°0.0°
C07C04C05H50.8°0.0°
C04C07H6H7120.0°120.0°
C04C07H6H8120.0°120.0°
C04C07H7H8120.0°120.0°
C04C03C02H4180.0°180.0°
C03C04C05C060.1°0.0°
C04C03C02N02179.8°180.0°
C04C03C02N010.5°0.3°
C03C04C05H5179.9°180.0°
C03C04C07H689.5°90.0°
C03C04C07H7150.5°150.0°
C03C04C07H830.4°30.0°
C05C04C03C020.5°0.0°
C04C05C06H5180.0°180.0°
C04C05C06N010.3°0.3°
C04C05C06C08179.3°180.0°
C05C04C03H4179.6°180.0°
C05C04C07H689.6°90.0°
C05C04C07H730.4°30.0°
C05C04C07H8150.4°150.0°
C03C02N02N01179.8°179.7°
C03C02N01C060.1°0.6°
C03C02N02H27179.8°179.7°
C03C02N02H2859.8°0.3°
C05C06N01C020.3°0.6°
C05C06N01C08179.6°179.7°
C05C06C08C0996.4°125.0°
C05C06C08H923.5°115.0°
C05C06C08H10143.7°5.0°
N02C02N01C06179.9°179.7°
N02C02C03H40.2°0.0°
C02N02H27H28120.0°180.0°
C02N01C06C08179.3°179.7°
N01C02C03H4179.6°179.7°
N01C02N02H270.0°0.1°
N01C02N02H28120.0°180.0°
N01C06C08C0984.0°54.7°
N01C06C05H5179.7°179.7°
N01C06C08H9156.1°65.3°
N01C06C08H1035.9°174.7°
C06C08C09H9119.9°120.1°
C06C08C09H10119.9°120.0°
C06C08C09C11114.0°180.0°
C08C06C05H50.7°0.0°
C06C08H9H10120.3°120.1°
C06C08C09H11126.1°59.9°
C06C08C09H125.9°60.0°
F13C13C14C12180.0°179.7°
F13C13C14C15179.7°179.7°
F13C13C12C11179.9°179.7°
F13C13C14H130.3°0.3°
F13C13C12H180.0°0.2°
C08C09C11C1296.8°90.0°
C08C09C11C1682.9°89.9°
C08C09C11H11119.9°120.0°
C08C09C11H12119.9°120.0°
C09C08H9H10120.3°119.9°
C08C09H11H12120.2°119.9°
C13C14C15H13180.0°179.9°
C14C13C12C110.0°0.0°
C13C14C15C17179.7°180.0°
C13C14C15C160.4°0.1°
C14C13C12H18180.0°179.9°
C12C13C14C150.2°0.1°
C13C12C11H18180.0°180.0°
C13C12C11C160.0°0.0°
C13C12C11C09179.7°180.0°
C12C13C14H13179.7°180.0°
C14C15C17C16179.3°179.9°
C14C15C16C110.4°0.1°
C14C15C17C18158.8°90.0°
C14C15C17H138.4°30.0°
C14C15C17H280.8°150.0°
C14C15C16H19179.6°180.0°
C12C11C16C150.2°0.1°
C12C11C16C09179.7°179.9°
C12C11C09H11143.3°150.0°
C12C11C09H1223.1°30.0°
C12C11C16H19179.8°180.0°
C17C15C16C11179.6°180.0°
C15C17C18H1120.4°120.1°
C15C17C18H2120.4°120.0°
C15C17C18C22121.4°174.4°
C15C17H1H2118.8°120.0°
C17C15C14H130.3°0.1°
C17C15C16H190.4°0.1°
C15C17C18H20118.5°54.4°
C15C17C18H211.3°65.6°
C15C16C11H19180.0°179.9°
C15C16C11C09179.9°180.0°
C16C15C17C1821.9°90.0°
C16C15C17H1142.3°149.9°
C16C15C17H298.5°30.0°
C16C15C14H13179.6°180.0°
C16C11C09H1137.0°30.1°
C16C11C09H12157.2°150.1°
C16C11C12H18180.0°179.9°
C11C09C08H95.9°59.9°
C11C09C08H10126.1°60.0°
C11C09H11H12120.3°120.0°
C09C11C12H180.3°0.0°
C09C11C16H190.1°0.1°
C17C18C22H20120.1°120.0°
C17C18C22H21120.1°120.0°
C17C18C22C2357.3°179.4°
C17C18C22N21177.2°65.2°
C18C17H1H2118.8°120.0°
C17C18C22H362.3°57.0°
C17C18H20H21119.7°120.0°
C18C22C23N21122.3°118.8°
C18C22C23H3119.5°122.3°
C18C22C23C24140.0°155.9°
C18C22N21H3120.1°122.2°
C18C22N21C25126.8°143.0°
C18C22N21C26115.1°94.7°
C22C18C17H11.0°65.5°
C22C18C17H2118.2°54.4°
C18C22C23H14100.7°86.0°
C18C22C23H1520.6°37.9°
C22C18H20H21119.7°120.0°
C22C23C24H14119.4°118.1°
C22C23C24H15119.4°118.1°
C23C22N21H3117.7°118.8°
C22C23C24C2523.5°35.7°
C23C22N21C254.6°24.1°
C23C22N21C26122.7°146.4°
C22C23H14H15121.9°123.9°
C23C22C18H2062.8°59.4°
C23C22C18H21177.4°60.6°
C22C23C24H2295.8°82.7°
C22C23C24H23142.8°154.1°
C24C23C22N2117.7°37.1°
C23C24C25H22119.3°118.3°
C23C24C25H23119.3°118.4°
C23C24C25N2121.1°22.3°
C24C23C22H3100.5°81.7°
C24C23H14H15121.8°123.8°
C23C24C25H16140.8°141.6°
C23C24C25H1798.6°97.3°
C23C24H22H23121.9°123.2°
C22N21C25C2410.3°1.0°
C22N21C25C26118.1°122.2°
N21C22C23H14137.0°155.2°
N21C22C23H15101.7°81.0°
C22N21C25H16130.0°118.4°
C22N21C25H17109.3°120.5°
N21C22C18H2057.1°174.8°
N21C22C18H2162.7°54.8°
C22N21C26H24180.0°66.2°
C22N21C26H2560.0°173.8°
C22N21C26H2660.0°53.8°
C24C25N21H16119.7°119.4°
C24C25N21H17119.7°119.5°
C24C25N21C26107.8°123.2°
C25C24C23H14142.9°153.8°
C25C24C23H1595.9°82.5°
C24C25H16H17121.0°121.1°
C25C24H22H23122.0°123.2°
C25N21C22H3113.1°94.7°
N21C25H16H17121.0°121.1°
N21C25C24H2298.3°96.1°
N21C25C24H23140.4°140.7°
C25N21C26H2461.5°54.6°
C25N21C26H25178.5°65.4°
C25N21C26H2658.5°174.6°
C26N21C22H35.0°27.5°
C26N21C25H1611.9°3.8°
C26N21C25H17132.6°117.3°
N21C26H24H25120.0°120.0°
N21C26H24H26120.0°120.0°
N21C26H25H26120.0°120.0°
H1C17C18H20121.1°174.5°
H1C17C18H21119.1°54.5°
H2C17C18H201.9°65.6°
H2C17C18H21121.7°174.4°
H3C22C23H1418.9°36.3°
H3C22C23H15140.1°160.2°
H3C22C18H20177.7°63.0°
H3C22C18H2157.8°177.1°
H6C07H7H8120.0°120.0°
H9C08C09H11114.0°180.0°
H9C08C09H12125.8°60.1°
H10C08C09H116.2°60.1°
H10C08C09H12114.0°180.0°
H14C23C24H2223.5°35.4°
H14C23C24H2397.8°87.8°
H15C23C24H22144.8°159.2°
H15C23C24H2323.5°35.9°
H16C25C24H2221.4°23.3°
H16C25C24H2399.9°100.0°
H17C25C24H22142.1°144.4°
H17C25C24H2320.8°21.2°
H24C26H25H26120.0°120.0°

222624

PDB entries from 2024-07-17

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